4-[4-[(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]piperazin-1-yl]-N-naphthalen-2-yl-3-nitro-benzamide

Systemtic Name: 4-[4-[(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]piperazin-1-yl]-N-naphthalen-2-yl-3-nitro-benzamide Openeye Name: 4-[4-[(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl]piperazin-1-yl]-N-(2-naphthyl)-3-nitro-benzamide CAS Name: 4-[4-[(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl]-1-piperazinyl]-N-(2-naphthalenyl)-3-nitrobenzamide IUPAC Name: 4-[4-[(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl]piperazin-1-yl]-N-naphthalen-2-yl-3-nitrobenzamide Traditional Name: 4-[4-[(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl]piperazino]-N-(2-naphthyl)-3-nitro-benzamide Formula: C27H29N5O4 MolecularWeight: 487.55026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4=CC5=CC=CC=C5C=C4)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NC1CC1)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4=CC5=CC=CC=C5C=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H29N5O4/c1-18(26(33)28-22-9-10-22)30-12-14-31(15-13-30)24-11-7-21(17-25(24)32(35)36)27(34)29-23-8-6-19-4-2-3-5-20(19)16-23/h2-8,11,16-18,22H,9-10,12-15H2,1H3,(H,28,33)(H,29,34)/t18-/m1/s1