5-azanyl-6-(1H-indol-3-yl)-1-(4-nitrophenyl)-4-oxidanyl-2-(phenylmethyl)hexan-3-one

Systemtic Name: 5-azanyl-6-(1H-indol-3-yl)-1-(4-nitrophenyl)-4-oxidanyl-2-(phenylmethyl)hexan-3-one Openeye Name: 5-amino-2-benzyl-4-hydroxy-6-(1H-indol-3-yl)-1-(4-nitrophenyl)hexan-3-one CAS Name: 5-amino-4-hydroxy-6-(1H-indol-3-yl)-1-(4-nitrophenyl)-2-(phenylmethyl)-3-hexanone IUPAC Name: 5-amino-2-benzyl-4-hydroxy-6-(1H-indol-3-yl)-1-(4-nitrophenyl)hexan-3-one Traditional Name: 5-amino-2-benzyl-4-hydroxy-6-(1H-indol-3-yl)-1-(4-nitrophenyl)hexan-3-one Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C(C(CC3=CNC4=CC=CC=C43)N)O

Isomeric SMILES

C1=CC=C(C=C1)CC(CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C(C(CC3=CNC4=CC=CC=C43)N)O

InChI

InChI=1S/C27H27N3O4/c28-24(16-21-17-29-25-9-5-4-8-23(21)25)27(32)26(31)20(14-18-6-2-1-3-7-18)15-19-10-12-22(13-11-19)30(33)34/h1-13,17,20,24,27,29,32H,14-16,28H2