prop-2-enyl (2R)-2-[(4-carbamimidoylphenyl)carbonylamino]-3-(3,4-dichlorophenyl)propanoate

Systemtic Name: prop-2-enyl (2R)-2-[(4-carbamimidoylphenyl)carbonylamino]-3-(3,4-dichlorophenyl)propanoate Openeye Name: allyl (2R)-2-[(4-carbamimidoylbenzoyl)amino]-3-(3,4-dichlorophenyl)propanoate CAS Name: (2R)-2-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-3-(3,4-dichlorophenyl)propanoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2R)-2-[(4-carbamimidoylbenzoyl)amino]-3-(3,4-dichlorophenyl)propanoate Traditional Name: (2R)-2-[(4-amidinobenzoyl)amino]-3-(3,4-dichlorophenyl)propionic acid allyl ester Formula: C20H19Cl2N3O3 MolecularWeight: 420.28916

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C(CC1=CC(=C(C=C1)Cl)Cl)NC(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C=CCOC(=O)[C@@H](CC1=CC(=C(C=C1)Cl)Cl)NC(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C20H19Cl2N3O3/c1-2-9-28-20(27)17(11-12-3-8-15(21)16(22)10-12)25-19(26)14-6-4-13(5-7-14)18(23)24/h2-8,10,17H,1,9,11H2,(H3,23,24)(H,25,26)/t17-/m1/s1