N'-(3-chlorophenyl)carbonyl-4-[(3S)-3-methylpiperidin-1-yl]-3-nitro-benzohydrazide

Systemtic Name: N'-(3-chlorophenyl)carbonyl-4-[(3S)-3-methylpiperidin-1-yl]-3-nitro-benzohydrazide Openeye Name: N'-(3-chlorobenzoyl)-4-[(3S)-3-methyl-1-piperidyl]-3-nitro-benzohydrazide CAS Name: N'-[(3-chlorophenyl)-oxomethyl]-4-[(3S)-3-methyl-1-piperidinyl]-3-nitrobenzohydrazide IUPAC Name: N'-(3-chlorobenzoyl)-4-[(3S)-3-methylpiperidin-1-yl]-3-nitrobenzohydrazide Traditional Name: N'-(3-chlorobenzoyl)-4-[(3S)-3-methylpiperidino]-3-nitro-benzohydrazide Formula: C20H21ClN4O4 MolecularWeight: 416.85814

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NNC(=O)C3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)C2=C(C=C(C=C2)C(=O)NNC(=O)C3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H21ClN4O4/c1-13-4-3-9-24(12-13)17-8-7-15(11-18(17)25(28)29)20(27)23-22-19(26)14-5-2-6-16(21)10-14/h2,5-8,10-11,13H,3-4,9,12H2,1H3,(H,22,26)(H,23,27)/t13-/m0/s1