3-(2-nitrophenyl)-2-[(E)-2-[1-(phenylmethyl)indol-3-yl]ethenyl]quinazolin-4-one

Systemtic Name: 3-(2-nitrophenyl)-2-[(E)-2-[1-(phenylmethyl)indol-3-yl]ethenyl]quinazolin-4-one Openeye Name: 2-[(E)-2-(1-benzylindol-3-yl)vinyl]-3-(2-nitrophenyl)quinazolin-4-one CAS Name: 3-(2-nitrophenyl)-2-[(E)-2-[1-(phenylmethyl)-3-indolyl]ethenyl]-4-quinazolinone IUPAC Name: 2-[(E)-2-(1-benzylindol-3-yl)ethenyl]-3-(2-nitrophenyl)quinazolin-4-one Traditional Name: 2-[(E)-2-(1-benzylindol-3-yl)vinyl]-3-(2-nitrophenyl)quinazolin-4-one Formula: C31H22N4O3 MolecularWeight: 498.53138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C=CC4=NC5=CC=CC=C5C(=O)N4C6=CC=CC=C6[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)/C=C/C4=NC5=CC=CC=C5C(=O)N4C6=CC=CC=C6[N+](=O)[O-]

InChI

InChI=1S/C31H22N4O3/c36-31-25-13-4-6-14-26(25)32-30(34(31)28-16-8-9-17-29(28)35(37)38)19-18-23-21-33(20-22-10-2-1-3-11-22)27-15-7-5-12-24(23)27/h1-19,21H,20H2/b19-18+