methyl 3-[4-(2-azanylethyl)-3-(imidazol-1-ylmethyl)-2-methyl-indol-1-yl]propanoate

Systemtic Name: methyl 3-[4-(2-azanylethyl)-3-(imidazol-1-ylmethyl)-2-methyl-indol-1-yl]propanoate Openeye Name: methyl 3-[4-(2-aminoethyl)-3-(imidazol-1-ylmethyl)-2-methyl-indol-1-yl]propanoate CAS Name: 3-[4-(2-aminoethyl)-3-(1-imidazolylmethyl)-2-methyl-1-indolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(2-aminoethyl)-3-(imidazol-1-ylmethyl)-2-methylindol-1-yl]propanoate Traditional Name: 3-[4-(2-aminoethyl)-3-(imidazol-1-ylmethyl)-2-methyl-indol-1-yl]propionic acid methyl ester Formula: C19H24N4O2 MolecularWeight: 340.41946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=CC=C2N1CCC(=O)OC)CCN)CN3C=CN=C3

Isomeric SMILES

CC1=C(C2=C(C=CC=C2N1CCC(=O)OC)CCN)CN3C=CN=C3

InChI

InChI=1S/C19H24N4O2/c1-14-16(12-22-11-9-21-13-22)19-15(6-8-20)4-3-5-17(19)23(14)10-7-18(24)25-2/h3-5,9,11,13H,6-8,10,12,20H2,1-2H3