4-(cyclopropylamino)-3-nitro-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzamide

Systemtic Name: 4-(cyclopropylamino)-3-nitro-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-4-(cyclopropylamino)-3-nitro-benzamide CAS Name: 4-(cyclopropylamino)-3-nitro-N-[1-(phenylmethyl)-3-pyrrolidinyl]benzamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-4-(cyclopropylamino)-3-nitrobenzamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-4-(cyclopropylamino)-3-nitro-benzamide Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)NC3CCN(C3)CC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)NC3CCN(C3)CC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O3/c26-21(16-6-9-19(22-17-7-8-17)20(12-16)25(27)28)23-18-10-11-24(14-18)13-15-4-2-1-3-5-15/h1-6,9,12,17-18,22H,7-8,10-11,13-14H2,(H,23,26)