dimethyl 2-[(E)-4-(3-aminophenyl)but-3-en-2-yl]-2-chloranyl-propanedioate

Systemtic Name: dimethyl 2-[(E)-4-(3-aminophenyl)but-3-en-2-yl]-2-chloranyl-propanedioate Openeye Name: dimethyl 2-[(E)-3-(3-aminophenyl)-1-methyl-allyl]-2-chloro-propanedioate CAS Name: 2-[(E)-4-(3-aminophenyl)but-3-en-2-yl]-2-chloropropanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(E)-4-(3-aminophenyl)but-3-en-2-yl]-2-chloropropanedioate Traditional Name: 2-[(E)-3-(3-aminophenyl)-1-methyl-allyl]-2-chloro-malonic acid dimethyl ester Formula: C15H18ClNO4 MolecularWeight: 311.76072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=CC1=CC(=CC=C1)N)C(C(=O)OC)(C(=O)OC)Cl

Isomeric SMILES

CC(/C=C/C1=CC(=CC=C1)N)C(C(=O)OC)(C(=O)OC)Cl

InChI

InChI=1S/C15H18ClNO4/c1-10(7-8-11-5-4-6-12(17)9-11)15(16,13(18)20-2)14(19)21-3/h4-10H,17H2,1-3H3/b8-7+