methyl 3-methyl-2-[(2-prop-2-ynoxyphenyl)methylamino]pentanoate

Systemtic Name: methyl 3-methyl-2-[(2-prop-2-ynoxyphenyl)methylamino]pentanoate Openeye Name: methyl 3-methyl-2-[(2-prop-2-ynoxyphenyl)methylamino]pentanoate CAS Name: 3-methyl-2-[(2-prop-2-ynoxyphenyl)methylamino]pentanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[(2-prop-2-ynoxyphenyl)methylamino]pentanoate Traditional Name: 3-methyl-2-[(2-propargyloxybenzyl)amino]valeric acid methyl ester Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NCC1=CC=CC=C1OCC#C

Isomeric SMILES

CCC(C)C(C(=O)OC)NCC1=CC=CC=C1OCC#C

InChI

InChI=1S/C17H23NO3/c1-5-11-21-15-10-8-7-9-14(15)12-18-16(13(3)6-2)17(19)20-4/h1,7-10,13,16,18H,6,11-12H2,2-4H3