methyl 2-[2-phenyl-3-(2-pyrrolidin-1-ylethoxy)pyrrolo[3,2-c]pyridin-1-yl]benzoate

Systemtic Name: methyl 2-[2-phenyl-3-(2-pyrrolidin-1-ylethoxy)pyrrolo[3,2-c]pyridin-1-yl]benzoate Openeye Name: methyl 2-[2-phenyl-3-(2-pyrrolidin-1-ylethoxy)pyrrolo[3,2-c]pyridin-1-yl]benzoate CAS Name: 2-[2-phenyl-3-[2-(1-pyrrolidinyl)ethoxy]-1-pyrrolo[3,2-c]pyridinyl]benzoic acid methyl ester IUPAC Name: methyl 2-[2-phenyl-3-(2-pyrrolidin-1-ylethoxy)pyrrolo[3,2-c]pyridin-1-yl]benzoate Traditional Name: 2-[2-phenyl-3-(2-pyrrolidinoethoxy)pyrrolo[3,2-c]pyridin-1-yl]benzoic acid methyl ester Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1N2C3=C(C=NC=C3)C(=C2C4=CC=CC=C4)OCCN5CCCC5

Isomeric SMILES

COC(=O)C1=CC=CC=C1N2C3=C(C=NC=C3)C(=C2C4=CC=CC=C4)OCCN5CCCC5

InChI

InChI=1S/C27H27N3O3/c1-32-27(31)21-11-5-6-12-23(21)30-24-13-14-28-19-22(24)26(25(30)20-9-3-2-4-10-20)33-18-17-29-15-7-8-16-29/h2-6,9-14,19H,7-8,15-18H2,1H3