(4-nitrophenyl)methyl N-[(2S)-3-[4-(2-dimethylaminoethyloxy)phenyl]-1-(dipropylamino)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: (4-nitrophenyl)methyl N-[(2S)-3-[4-(2-dimethylaminoethyloxy)phenyl]-1-(dipropylamino)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: (4-nitrophenyl)methyl N-[(1S)-1-[[4-(2-dimethylaminoethyloxy)phenyl]methyl]-2-(dipropylamino)-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-3-[4-(2-dimethylaminoethyloxy)phenyl]-1-(dipropylamino)-1-oxopropan-2-yl]carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-[(2S)-3-[4-(2-dimethylaminoethyloxy)phenyl]-1-(dipropylamino)-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-1-[4-(2-dimethylaminoethyloxy)benzyl]-2-(dipropylamino)-2-keto-ethyl]carbamic acid (4-nitrobenzyl) ester Formula: C27H38N4O6 MolecularWeight: 514.61382

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C(CC1=CC=C(C=C1)OCCN(C)C)NC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCN(CCC)C(=O)[C@H](CC1=CC=C(C=C1)OCCN(C)C)NC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C27H38N4O6/c1-5-15-30(16-6-2)26(32)25(19-21-9-13-24(14-10-21)36-18-17-29(3)4)28-27(33)37-20-22-7-11-23(12-8-22)31(34)35/h7-14,25H,5-6,15-20H2,1-4H3,(H,28,33)/t25-/m0/s1