aniline; 3-(4-azanyl-3,5-diethoxy-phenyl)but-3-enoic acid

Systemtic Name: aniline; 3-(4-azanyl-3,5-diethoxy-phenyl)but-3-enoic acid Openeye Name: 3-(4-amino-3,5-diethoxy-phenyl)but-3-enoic acid; aniline CAS Name: 3-(4-amino-3,5-diethoxyphenyl)-3-butenoic acid; aniline IUPAC Name: 3-(4-amino-3,5-diethoxyphenyl)but-3-enoic acid; aniline Traditional Name: 3-(4-amino-3,5-diethoxy-phenyl)but-3-enoic acid; phenylamine Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1N)OCC)C(=C)CC(=O)O.C1=CC=C(C=C1)N

Isomeric SMILES

CCOC1=CC(=CC(=C1N)OCC)C(=C)CC(=O)O.C1=CC=C(C=C1)N

InChI

InChI=1S/C14H19NO4.C6H7N/c1-4-18-11-7-10(9(3)6-13(16)17)8-12(14(11)15)19-5-2;7-6-4-2-1-3-5-6/h7-8H,3-6,15H2,1-2H3,(H,16,17);1-5H,7H2