ethyl 5-methoxy-3-[2-[(phenylmethyl)amino]ethanoylamino]-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-methoxy-3-[2-[(phenylmethyl)amino]ethanoylamino]-1H-indole-2-carboxylate Openeye Name: ethyl 3-[[2-(benzylamino)acetyl]amino]-5-methoxy-1H-indole-2-carboxylate CAS Name: 5-methoxy-3-[[1-oxo-2-[(phenylmethyl)amino]ethyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(benzylamino)acetyl]amino]-5-methoxy-1H-indole-2-carboxylate Traditional Name: 3-[[2-(benzylamino)acetyl]amino]-5-methoxy-1H-indole-2-carboxylic acid ethyl ester Formula: C21H23N3O4 MolecularWeight: 381.42502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)CNCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)CNCC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O4/c1-3-28-21(26)20-19(16-11-15(27-2)9-10-17(16)23-20)24-18(25)13-22-12-14-7-5-4-6-8-14/h4-11,22-23H,3,12-13H2,1-2H3,(H,24,25)