O4-[3-(2-azanylethyl)-1H-indol-5-yl] O1-(phenylmethyl) butanedioate hydrochloride

Systemtic Name: O4-[3-(2-azanylethyl)-1H-indol-5-yl] O1-(phenylmethyl) butanedioate hydrochloride Openeye Name: O4-[3-(2-aminoethyl)-1H-indol-5-yl] O1-benzyl butanedioate hydrochloride CAS Name: butanedioic acid O4-[3-(2-aminoethyl)-1H-indol-5-yl] ester O1-(phenylmethyl) ester hydrochloride IUPAC Name: 4-O-[3-(2-aminoethyl)-1H-indol-5-yl] 1-O-benzyl butanedioate hydrochloride Traditional Name: succinic acid O4-[3-(2-aminoethyl)-1H-indol-5-yl] ester O1-benzyl ester hydrochloride Formula: C21H23ClN2O4 MolecularWeight: 402.87132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCC(=O)OC2=CC3=C(C=C2)NC=C3CCN.Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCC(=O)OC2=CC3=C(C=C2)NC=C3CCN.Cl

InChI

InChI=1S/C21H22N2O4.ClH/c22-11-10-16-13-23-19-7-6-17(12-18(16)19)27-21(25)9-8-20(24)26-14-15-4-2-1-3-5-15;/h1-7,12-13,23H,8-11,14,22H2;1H