methyl (2S)-3-[4-(3-indol-1-ylpropylamino)phenyl]-2-methoxy-propanoate

Systemtic Name: methyl (2S)-3-[4-(3-indol-1-ylpropylamino)phenyl]-2-methoxy-propanoate Openeye Name: methyl (2S)-3-[4-(3-indol-1-ylpropylamino)phenyl]-2-methoxy-propanoate CAS Name: (2S)-3-[4-[3-(1-indolyl)propylamino]phenyl]-2-methoxypropanoic acid methyl ester IUPAC Name: methyl (2S)-3-[4-(3-indol-1-ylpropylamino)phenyl]-2-methoxypropanoate Traditional Name: (2S)-3-[4-(3-indol-1-ylpropylamino)phenyl]-2-methoxy-propionic acid methyl ester Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC1=CC=C(C=C1)NCCCN2C=CC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CO[C@@H](CC1=CC=C(C=C1)NCCCN2C=CC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C22H26N2O3/c1-26-21(22(25)27-2)16-17-8-10-19(11-9-17)23-13-5-14-24-15-12-18-6-3-4-7-20(18)24/h3-4,6-12,15,21,23H,5,13-14,16H2,1-2H3/t21-/m0/s1