1-[(3-chlorophenyl)amino]-3-[1-(3-oxidanylpropyl)indol-3-yl]pyrrole-2,5-dione

Systemtic Name: 1-[(3-chlorophenyl)amino]-3-[1-(3-oxidanylpropyl)indol-3-yl]pyrrole-2,5-dione Openeye Name: 1-(3-chloroanilino)-3-[1-(3-hydroxypropyl)indol-3-yl]pyrrole-2,5-dione CAS Name: 1-(3-chloroanilino)-3-[1-(3-hydroxypropyl)-3-indolyl]pyrrole-2,5-dione IUPAC Name: 1-(3-chloroanilino)-3-[1-(3-hydroxypropyl)indol-3-yl]pyrrole-2,5-dione Traditional Name: 1-(3-chloroanilino)-3-[1-(3-hydroxypropyl)indol-3-yl]-3-pyrroline-2,5-quinone Formula: C21H18ClN3O3 MolecularWeight: 395.83892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCCO)C3=CC(=O)N(C3=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCCO)C3=CC(=O)N(C3=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H18ClN3O3/c22-14-5-3-6-15(11-14)23-25-20(27)12-17(21(25)28)18-13-24(9-4-10-26)19-8-2-1-7-16(18)19/h1-3,5-8,11-13,23,26H,4,9-10H2