(3S)-3-azaniumyl-3-(2-butoxynaphthalen-1-yl)propanoate

Systemtic Name: (3S)-3-azaniumyl-3-(2-butoxynaphthalen-1-yl)propanoate Openeye Name: (3S)-3-azaniumyl-3-(2-butoxy-1-naphthyl)propanoate CAS Name: (3S)-3-ammonio-3-(2-butoxy-1-naphthalenyl)propanoate IUPAC Name: (3S)-3-azaniumyl-3-(2-butoxynaphthalen-1-yl)propanoate Traditional Name: (3S)-3-ammonio-3-(2-butoxy-1-naphthyl)propionate Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C2=CC=CC=C2C=C1)C(CC(=O)[O-])[NH3+]

Isomeric SMILES

CCCCOC1=C(C2=CC=CC=C2C=C1)[C@H](CC(=O)[O-])[NH3+]

InChI

InChI=1S/C17H21NO3/c1-2-3-10-21-15-9-8-12-6-4-5-7-13(12)17(15)14(18)11-16(19)20/h4-9,14H,2-3,10-11,18H2,1H3,(H,19,20)/t14-/m0/s1