(phenylmethyl) 2-[4-[(5-fluoranyl-1H-indol-2-yl)carbonyl]-1,4-diazepan-1-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[4-[(5-fluoranyl-1H-indol-2-yl)carbonyl]-1,4-diazepan-1-yl]ethanoate Openeye Name: benzyl 2-[4-(5-fluoro-1H-indole-2-carbonyl)-1,4-diazepan-1-yl]acetate CAS Name: 2-[4-[(5-fluoro-1H-indol-2-yl)-oxomethyl]-1,4-diazepan-1-yl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[4-(5-fluoro-1H-indole-2-carbonyl)-1,4-diazepan-1-yl]acetate Traditional Name: 2-[4-(5-fluoro-1H-indole-2-carbonyl)-1,4-diazepan-1-yl]acetic acid benzyl ester Formula: C23H24FN3O3 MolecularWeight: 409.453363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC3=C(N2)C=CC(=C3)F)CC(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC3=C(N2)C=CC(=C3)F)CC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C23H24FN3O3/c24-19-7-8-20-18(13-19)14-21(25-20)23(29)27-10-4-9-26(11-12-27)15-22(28)30-16-17-5-2-1-3-6-17/h1-3,5-8,13-14,25H,4,9-12,15-16H2