methyl 2-[(3-methoxy-4-oxidanyl-phenyl)methylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[(3-methoxy-4-oxidanyl-phenyl)methylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[(4-hydroxy-3-methoxy-phenyl)methylamino]-4-methyl-pentanoate CAS Name: 2-[(4-hydroxy-3-methoxyphenyl)methylamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(4-hydroxy-3-methoxyphenyl)methylamino]-4-methylpentanoate Traditional Name: 4-methyl-2-(vanillylamino)valeric acid methyl ester Formula: C15H23NO4 MolecularWeight: 281.34742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NCC1=CC(=C(C=C1)O)OC

Isomeric SMILES

CC(C)CC(C(=O)OC)NCC1=CC(=C(C=C1)O)OC

InChI

InChI=1S/C15H23NO4/c1-10(2)7-12(15(18)20-4)16-9-11-5-6-13(17)14(8-11)19-3/h5-6,8,10,12,16-17H,7,9H2,1-4H3