N-(1-cyclopropylpiperidin-4-yl)-4-[(3S)-3-methylpiperidin-1-yl]-3-nitro-benzamide

Systemtic Name: N-(1-cyclopropylpiperidin-4-yl)-4-[(3S)-3-methylpiperidin-1-yl]-3-nitro-benzamide Openeye Name: N-(1-cyclopropyl-4-piperidyl)-4-[(3S)-3-methyl-1-piperidyl]-3-nitro-benzamide CAS Name: N-(1-cyclopropyl-4-piperidinyl)-4-[(3S)-3-methyl-1-piperidinyl]-3-nitrobenzamide IUPAC Name: N-(1-cyclopropylpiperidin-4-yl)-4-[(3S)-3-methylpiperidin-1-yl]-3-nitrobenzamide Traditional Name: N-(1-cyclopropyl-4-piperidyl)-4-[(3S)-3-methylpiperidino]-3-nitro-benzamide Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3CCN(CC3)C4CC4)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3CCN(CC3)C4CC4)[N+](=O)[O-]

InChI

InChI=1S/C21H30N4O3/c1-15-3-2-10-24(14-15)19-7-4-16(13-20(19)25(27)28)21(26)22-17-8-11-23(12-9-17)18-5-6-18/h4,7,13,15,17-18H,2-3,5-6,8-12,14H2,1H3,(H,22,26)/t15-/m0/s1