ethyl 3-[3-(cyclopropylcarbamoylamino)phenyl]-1-[(3-methoxyphenyl)methyl]indole-2-carboxylate

Systemtic Name: ethyl 3-[3-(cyclopropylcarbamoylamino)phenyl]-1-[(3-methoxyphenyl)methyl]indole-2-carboxylate Openeye Name: ethyl 3-[3-(cyclopropylcarbamoylamino)phenyl]-1-[(3-methoxyphenyl)methyl]indole-2-carboxylate CAS Name: 3-[3-[[(cyclopropylamino)-oxomethyl]amino]phenyl]-1-[(3-methoxyphenyl)methyl]-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[3-(cyclopropylcarbamoylamino)phenyl]-1-[(3-methoxyphenyl)methyl]indole-2-carboxylate Traditional Name: 3-[3-(cyclopropylcarbamoylamino)phenyl]-1-m-anisyl-indole-2-carboxylic acid ethyl ester Formula: C29H29N3O4 MolecularWeight: 483.55826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N1CC3=CC(=CC=C3)OC)C4=CC(=CC=C4)NC(=O)NC5CC5

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N1CC3=CC(=CC=C3)OC)C4=CC(=CC=C4)NC(=O)NC5CC5

InChI

InChI=1S/C29H29N3O4/c1-3-36-28(33)27-26(20-9-7-10-22(17-20)31-29(34)30-21-14-15-21)24-12-4-5-13-25(24)32(27)18-19-8-6-11-23(16-19)35-2/h4-13,16-17,21H,3,14-15,18H2,1-2H3,(H2,30,31,34)