methyl 6-[2-azanylethyl-(phenylmethyl)amino]-5-oxidanylidene-hexanoate

Systemtic Name: methyl 6-[2-azanylethyl-(phenylmethyl)amino]-5-oxidanylidene-hexanoate Openeye Name: methyl 6-[2-aminoethyl(benzyl)amino]-5-oxo-hexanoate CAS Name: 6-[2-aminoethyl-(phenylmethyl)amino]-5-oxohexanoic acid methyl ester IUPAC Name: methyl 6-[2-aminoethyl(benzyl)amino]-5-oxohexanoate Traditional Name: 6-[2-aminoethyl(benzyl)amino]-5-keto-hexanoic acid methyl ester Formula: C16H24N2O3 MolecularWeight: 292.37336

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)CN(CCN)CC1=CC=CC=C1

Isomeric SMILES

COC(=O)CCCC(=O)CN(CCN)CC1=CC=CC=C1

InChI

InChI=1S/C16H24N2O3/c1-21-16(20)9-5-8-15(19)13-18(11-10-17)12-14-6-3-2-4-7-14/h2-4,6-7H,5,8-13,17H2,1H3