ethyl 4-(cyclopropylmethyl)-1-(1H-indol-2-ylmethyl)piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 4-(cyclopropylmethyl)-1-(1H-indol-2-ylmethyl)piperidin-1-ium-4-carboxylate Openeye Name: ethyl 4-(cyclopropylmethyl)-1-(1H-indol-2-ylmethyl)piperidin-1-ium-4-carboxylate CAS Name: 4-(cyclopropylmethyl)-1-(1H-indol-2-ylmethyl)-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-(cyclopropylmethyl)-1-(1H-indol-2-ylmethyl)piperidin-1-ium-4-carboxylate Traditional Name: 4-(cyclopropylmethyl)-1-(1H-indol-2-ylmethyl)piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C21H29N2O2+ MolecularWeight: 341.46716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[NH+](CC1)CC2=CC3=CC=CC=C3N2)CC4CC4

Isomeric SMILES

CCOC(=O)C1(CC[NH+](CC1)CC2=CC3=CC=CC=C3N2)CC4CC4

InChI

InChI=1S/C21H28N2O2/c1-2-25-20(24)21(14-16-7-8-16)9-11-23(12-10-21)15-18-13-17-5-3-4-6-19(17)22-18/h3-6,13,16,22H,2,7-12,14-15H2,1H3/p+1