2-methylpropyl N-[8-[2-[[ethanoyl(ethyl)amino]methyl]-4-nitro-phenoxy]-6-(3-methoxypropylcarbamoyl)-5-oxidanyl-naphthalen-1-yl]carbamate

Systemtic Name: 2-methylpropyl N-[8-[2-[[ethanoyl(ethyl)amino]methyl]-4-nitro-phenoxy]-6-(3-methoxypropylcarbamoyl)-5-oxidanyl-naphthalen-1-yl]carbamate Openeye Name: isobutyl N-[8-[2-[[acetyl(ethyl)amino]methyl]-4-nitro-phenoxy]-5-hydroxy-6-(3-methoxypropylcarbamoyl)-1-naphthyl]carbamate CAS Name: N-[8-[2-[[acetyl(ethyl)amino]methyl]-4-nitrophenoxy]-5-hydroxy-6-[(3-methoxypropylamino)-oxomethyl]-1-naphthalenyl]carbamic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N-[8-[2-[[acetyl(ethyl)amino]methyl]-4-nitrophenoxy]-5-hydroxy-6-(3-methoxypropylcarbamoyl)naphthalen-1-yl]carbamate Traditional Name: N-[8-[2-[[acetyl(ethyl)amino]methyl]-4-nitro-phenoxy]-5-hydroxy-6-(3-methoxypropylcarbamoyl)-1-naphthyl]carbamic acid isobutyl ester Formula: C31H38N4O9 MolecularWeight: 610.65482

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)[N+](=O)[O-])OC2=C3C(=C(C(=C2)C(=O)NCCCOC)O)C=CC=C3NC(=O)OCC(C)C)C(=O)C

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)[N+](=O)[O-])OC2=C3C(=C(C(=C2)C(=O)NCCCOC)O)C=CC=C3NC(=O)OCC(C)C)C(=O)C

InChI

InChI=1S/C31H38N4O9/c1-6-34(20(4)36)17-21-15-22(35(40)41)11-12-26(21)44-27-16-24(30(38)32-13-8-14-42-5)29(37)23-9-7-10-25(28(23)27)33-31(39)43-18-19(2)3/h7,9-12,15-16,19,37H,6,8,13-14,17-18H2,1-5H3,(H,32,38)(H,33,39)