N-[3-[[(1S)-2-(dimethylamino)-1-phenyl-ethyl]amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[[(1S)-2-(dimethylamino)-1-phenyl-ethyl]amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-[[(1S)-2-(dimethylamino)-1-phenyl-ethyl]amino]-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[[(1S)-2-(dimethylamino)-1-phenylethyl]amino]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-[[(1S)-2-(dimethylamino)-1-phenylethyl]amino]-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-[[(1S)-2-(dimethylamino)-1-phenyl-ethyl]amino]-3-keto-propyl]-4-nitro-benzamide Formula: C20H24N4O4 MolecularWeight: 384.42896

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(C1=CC=CC=C1)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(C)C[C@H](C1=CC=CC=C1)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O4/c1-23(2)14-18(15-6-4-3-5-7-15)22-19(25)12-13-21-20(26)16-8-10-17(11-9-16)24(27)28/h3-11,18H,12-14H2,1-2H3,(H,21,26)(H,22,25)/t18-/m1/s1