2-[[2-azaniumyl-3-(4-hydroxyphenyl)propanoyl]amino]-3-phenyl-propanoate

Systemtic Name: 2-[[2-azaniumyl-3-(4-hydroxyphenyl)propanoyl]amino]-3-phenyl-propanoate Openeye Name: 2-[[2-azaniumyl-3-(4-hydroxyphenyl)propanoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[2-ammonio-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-3-phenylpropanoate IUPAC Name: 2-[[2-azaniumyl-3-(4-hydroxyphenyl)propanoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-ammonio-3-(4-hydroxyphenyl)propanoyl]amino]-3-phenyl-propionate Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])NC(=O)C(CC2=CC=C(C=C2)O)[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)[O-])NC(=O)C(CC2=CC=C(C=C2)O)[NH3+]

InChI

InChI=1S/C18H20N2O4/c19-15(10-13-6-8-14(21)9-7-13)17(22)20-16(18(23)24)11-12-4-2-1-3-5-12/h1-9,15-16,21H,10-11,19H2,(H,20,22)(H,23,24)