(phenylmethyl) 2-[4-[3-(ethylamino)pyridin-2-yl]piperazin-1-yl]carbonyl-1H-indole-5-carboxylate

Systemtic Name: (phenylmethyl) 2-[4-[3-(ethylamino)pyridin-2-yl]piperazin-1-yl]carbonyl-1H-indole-5-carboxylate Openeye Name: benzyl 2-[4-[3-(ethylamino)-2-pyridyl]piperazine-1-carbonyl]-1H-indole-5-carboxylate CAS Name: 2-[[4-[3-(ethylamino)-2-pyridinyl]-1-piperazinyl]-oxomethyl]-1H-indole-5-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[4-[3-(ethylamino)pyridin-2-yl]piperazine-1-carbonyl]-1H-indole-5-carboxylate Traditional Name: 2-[4-[3-(ethylamino)-2-pyridyl]piperazine-1-carbonyl]-1H-indole-5-carboxylic acid benzyl ester Formula: C28H29N5O3 MolecularWeight: 483.56156

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(N=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(N3)C=CC(=C4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CCNC1=C(N=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(N3)C=CC(=C4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C28H29N5O3/c1-2-29-24-9-6-12-30-26(24)32-13-15-33(16-14-32)27(34)25-18-22-17-21(10-11-23(22)31-25)28(35)36-19-20-7-4-3-5-8-20/h3-12,17-18,29,31H,2,13-16,19H2,1H3