(3S)-1-[2-(5-methoxyindol-1-yl)ethanoyl]piperidine-3-carboxylate

Systemtic Name: (3S)-1-[2-(5-methoxyindol-1-yl)ethanoyl]piperidine-3-carboxylate Openeye Name: (3S)-1-[2-(5-methoxyindol-1-yl)acetyl]piperidine-3-carboxylate CAS Name: (3S)-1-[2-(5-methoxy-1-indolyl)-1-oxoethyl]-3-piperidinecarboxylate IUPAC Name: (3S)-1-[2-(5-methoxyindol-1-yl)acetyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[2-(5-methoxyindol-1-yl)acetyl]nipecotate Formula: C17H19N2O4- MolecularWeight: 315.34376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C=C2)CC(=O)N3CCCC(C3)C(=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)N(C=C2)CC(=O)N3CCC[C@@H](C3)C(=O)[O-]

InChI

InChI=1S/C17H20N2O4/c1-23-14-4-5-15-12(9-14)6-8-18(15)11-16(20)19-7-2-3-13(10-19)17(21)22/h4-6,8-9,13H,2-3,7,10-11H2,1H3,(H,21,22)/p-1/t13-/m0/s1