methyl 3-oxidanyl-2-[3-[2-[(phenylmethyl)amino]ethyl]-1H-indol-2-yl]propanoate

Systemtic Name: methyl 3-oxidanyl-2-[3-[2-[(phenylmethyl)amino]ethyl]-1H-indol-2-yl]propanoate Openeye Name: methyl 2-[3-[2-(benzylamino)ethyl]-1H-indol-2-yl]-3-hydroxy-propanoate CAS Name: 3-hydroxy-2-[3-[2-[(phenylmethyl)amino]ethyl]-1H-indol-2-yl]propanoic acid methyl ester IUPAC Name: methyl 2-[3-[2-(benzylamino)ethyl]-1H-indol-2-yl]-3-hydroxypropanoate Traditional Name: 2-[3-[2-(benzylamino)ethyl]-1H-indol-2-yl]-3-hydroxy-propionic acid methyl ester Formula: C21H24N2O3 MolecularWeight: 352.42686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)C1=C(C2=CC=CC=C2N1)CCNCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C(CO)C1=C(C2=CC=CC=C2N1)CCNCC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O3/c1-26-21(25)18(14-24)20-17(16-9-5-6-10-19(16)23-20)11-12-22-13-15-7-3-2-4-8-15/h2-10,18,22-24H,11-14H2,1H3