(E,4S)-4-[bis(phenylmethyl)amino]-1-(3-nitrophenyl)pent-1-en-3-one

Systemtic Name: (E,4S)-4-[bis(phenylmethyl)amino]-1-(3-nitrophenyl)pent-1-en-3-one Openeye Name: (E,4S)-4-(dibenzylamino)-1-(3-nitrophenyl)pent-1-en-3-one CAS Name: (E,4S)-4-[bis(phenylmethyl)amino]-1-(3-nitrophenyl)-1-penten-3-one IUPAC Name: (E,4S)-4-(dibenzylamino)-1-(3-nitrophenyl)pent-1-en-3-one Traditional Name: (E,4S)-4-(dibenzylamino)-1-(3-nitrophenyl)pent-1-en-3-one Formula: C25H24N2O3 MolecularWeight: 400.46966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C=CC1=CC(=CC=C1)[N+](=O)[O-])N(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)/C=C/C1=CC(=CC=C1)[N+](=O)[O-])N(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C25H24N2O3/c1-20(25(28)16-15-21-13-8-14-24(17-21)27(29)30)26(18-22-9-4-2-5-10-22)19-23-11-6-3-7-12-23/h2-17,20H,18-19H2,1H3/b16-15+/t20-/m0/s1