methyl 5-azanyl-1-(diphenylmethyl)-4-ethanoyl-3,5-dimethyl-6-[4-(3-nitrophenyl)pyridin-3-yl]carbonyl-piperazine-2-carboxylate

Systemtic Name: methyl 5-azanyl-1-(diphenylmethyl)-4-ethanoyl-3,5-dimethyl-6-[4-(3-nitrophenyl)pyridin-3-yl]carbonyl-piperazine-2-carboxylate Openeye Name: methyl 4-acetyl-5-amino-1-benzhydryl-3,5-dimethyl-6-[4-(3-nitrophenyl)pyridine-3-carbonyl]piperazine-2-carboxylate CAS Name: 4-acetyl-5-amino-1-(diphenylmethyl)-3,5-dimethyl-6-[[4-(3-nitrophenyl)-3-pyridinyl]-oxomethyl]-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-acetyl-5-amino-1-benzhydryl-3,5-dimethyl-6-[4-(3-nitrophenyl)pyridine-3-carbonyl]piperazine-2-carboxylate Traditional Name: 4-acetyl-5-amino-1-benzhydryl-3,5-dimethyl-6-[4-(3-nitrophenyl)nicotinoyl]piperazine-2-carboxylic acid methyl ester Formula: C35H35N5O6 MolecularWeight: 621.6823

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(N(C(C(N1C(=O)C)(C)N)C(=O)C2=C(C=CN=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)OC

Isomeric SMILES

CC1C(N(C(C(N1C(=O)C)(C)N)C(=O)C2=C(C=CN=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C35H35N5O6/c1-22-30(34(43)46-4)38(31(24-12-7-5-8-13-24)25-14-9-6-10-15-25)33(35(3,36)39(22)23(2)41)32(42)29-21-37-19-18-28(29)26-16-11-17-27(20-26)40(44)45/h5-22,30-31,33H,36H2,1-4H3