methyl 2-[1-[4-[4-(aminomethyl)phenyl]piperidin-1-yl]carbonylpiperidin-4-yl]ethanoate

Systemtic Name: methyl 2-[1-[4-[4-(aminomethyl)phenyl]piperidin-1-yl]carbonylpiperidin-4-yl]ethanoate Openeye Name: methyl 2-[1-[4-[4-(aminomethyl)phenyl]piperidine-1-carbonyl]-4-piperidyl]acetate CAS Name: 2-[1-[[4-[4-(aminomethyl)phenyl]-1-piperidinyl]-oxomethyl]-4-piperidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-[4-[4-(aminomethyl)phenyl]piperidine-1-carbonyl]piperidin-4-yl]acetate Traditional Name: 2-[1-[4-[4-(aminomethyl)phenyl]piperidine-1-carbonyl]-4-piperidyl]acetic acid methyl ester Formula: C21H31N3O3 MolecularWeight: 373.48914

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CCN(CC1)C(=O)N2CCC(CC2)C3=CC=C(C=C3)CN

Isomeric SMILES

COC(=O)CC1CCN(CC1)C(=O)N2CCC(CC2)C3=CC=C(C=C3)CN

InChI

InChI=1S/C21H31N3O3/c1-27-20(25)14-16-6-10-23(11-7-16)21(26)24-12-8-19(9-13-24)18-4-2-17(15-22)3-5-18/h2-5,16,19H,6-15,22H2,1H3