prop-2-enyl 2-azanyl-5-[(4-azanyl-3-prop-2-enoxycarbonyl-phenyl)methyl]benzoate

Systemtic Name: prop-2-enyl 2-azanyl-5-[(4-azanyl-3-prop-2-enoxycarbonyl-phenyl)methyl]benzoate Openeye Name: allyl 5-[(3-allyloxycarbonyl-4-amino-phenyl)methyl]-2-amino-benzoate CAS Name: 2-amino-5-[[4-amino-3-[oxo(prop-2-enoxy)methyl]phenyl]methyl]benzoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-amino-5-[(4-amino-3-prop-2-enoxycarbonylphenyl)methyl]benzoate Traditional Name: 5-(3-allyloxycarbonyl-4-amino-benzyl)-2-amino-benzoic acid allyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C1=C(C=CC(=C1)CC2=CC(=C(C=C2)N)C(=O)OCC=C)N

Isomeric SMILES

C=CCOC(=O)C1=C(C=CC(=C1)CC2=CC(=C(C=C2)N)C(=O)OCC=C)N

InChI

InChI=1S/C21H22N2O4/c1-3-9-26-20(24)16-12-14(5-7-18(16)22)11-15-6-8-19(23)17(13-15)21(25)27-10-4-2/h3-8,12-13H,1-2,9-11,22-23H2