N-[3-(butan-2-ylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[3-(butan-2-ylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(sec-butylcarbamoyl)phenyl]-4-methyl-3-nitro-benzamide CAS Name: N-[3-[(butan-2-ylamino)-oxomethyl]-4-[4-(2-methoxyphenyl)-1-piperazinyl]phenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[3-(butan-2-ylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[4-[4-(2-methoxyphenyl)piperazino]-3-(sec-butylcarbamoyl)phenyl]-4-methyl-3-nitro-benzamide Formula: C30H35N5O5 MolecularWeight: 545.6294

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C30H35N5O5/c1-5-21(3)31-30(37)24-19-23(32-29(36)22-11-10-20(2)27(18-22)35(38)39)12-13-25(24)33-14-16-34(17-15-33)26-8-6-7-9-28(26)40-4/h6-13,18-19,21H,5,14-17H2,1-4H3,(H,31,37)(H,32,36)