N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-4-(cyclopropylamino)-3-nitro-benzamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-4-(cyclopropylamino)-3-nitro-benzamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-4-(cyclopropylamino)-3-nitro-benzamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidinyl]-4-(cyclopropylamino)-3-nitrobenzamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-(cyclopropylamino)-3-nitrobenzamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)-4-piperidyl]-4-(cyclopropylamino)-3-nitro-benzamide Formula: C17H23N5O4 MolecularWeight: 361.39562

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)NC3CCN(CC3)CC(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)NC3CCN(CC3)CC(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C17H23N5O4/c18-16(23)10-21-7-5-13(6-8-21)20-17(24)11-1-4-14(19-12-2-3-12)15(9-11)22(25)26/h1,4,9,12-13,19H,2-3,5-8,10H2,(H2,18,23)(H,20,24)