2-[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]-2-(5-methyl-1H-indol-3-yl)ethanoic acid

Systemtic Name: 2-[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]-2-(5-methyl-1H-indol-3-yl)ethanoic acid Openeye Name: 2-[4-[2-(dimethylamino)-2-oxo-ethyl]piperazin-1-yl]-2-(5-methyl-1H-indol-3-yl)acetic acid CAS Name: 2-[4-[2-(dimethylamino)-2-oxoethyl]-1-piperazinyl]-2-(5-methyl-1H-indol-3-yl)acetic acid IUPAC Name: 2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]-2-(5-methyl-1H-indol-3-yl)acetic acid Traditional Name: 2-[4-[2-(dimethylamino)-2-keto-ethyl]piperazino]-2-(5-methyl-1H-indol-3-yl)acetic acid Formula: C19H26N4O3 MolecularWeight: 358.43474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCN(CC3)CC(=O)N(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCN(CC3)CC(=O)N(C)C

InChI

InChI=1S/C19H26N4O3/c1-13-4-5-16-14(10-13)15(11-20-16)18(19(25)26)23-8-6-22(7-9-23)12-17(24)21(2)3/h4-5,10-11,18,20H,6-9,12H2,1-3H3,(H,25,26)