3-(4-fluorophenyl)-3-[5-nitro-1-(phenylmethyl)indol-3-yl]-N-(2-pyrrolidin-1-ylethyl)propanamide

Systemtic Name: 3-(4-fluorophenyl)-3-[5-nitro-1-(phenylmethyl)indol-3-yl]-N-(2-pyrrolidin-1-ylethyl)propanamide Openeye Name: 3-(1-benzyl-5-nitro-indol-3-yl)-3-(4-fluorophenyl)-N-(2-pyrrolidin-1-ylethyl)propanamide CAS Name: 3-(4-fluorophenyl)-3-[5-nitro-1-(phenylmethyl)-3-indolyl]-N-[2-(1-pyrrolidinyl)ethyl]propanamide IUPAC Name: 3-(1-benzyl-5-nitroindol-3-yl)-3-(4-fluorophenyl)-N-(2-pyrrolidin-1-ylethyl)propanamide Traditional Name: 3-(1-benzyl-5-nitro-indol-3-yl)-3-(4-fluorophenyl)-N-(2-pyrrolidinoethyl)propionamide Formula: C30H31FN4O3 MolecularWeight: 514.590543

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCNC(=O)CC(C2=CC=C(C=C2)F)C3=CN(C4=C3C=C(C=C4)[N+](=O)[O-])CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)CCNC(=O)CC(C2=CC=C(C=C2)F)C3=CN(C4=C3C=C(C=C4)[N+](=O)[O-])CC5=CC=CC=C5

InChI

InChI=1S/C30H31FN4O3/c31-24-10-8-23(9-11-24)26(19-30(36)32-14-17-33-15-4-5-16-33)28-21-34(20-22-6-2-1-3-7-22)29-13-12-25(35(37)38)18-27(28)29/h1-3,6-13,18,21,26H,4-5,14-17,19-20H2,(H,32,36)