ethyl 4-[3-[7-chloranyl-3-oxidanylidene-4-(phenylmethyl)quinoxalin-2-yl]propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-[7-chloranyl-3-oxidanylidene-4-(phenylmethyl)quinoxalin-2-yl]propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(4-benzyl-7-chloro-3-oxo-quinoxalin-2-yl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-[7-chloro-3-oxo-4-(phenylmethyl)-2-quinoxalinyl]-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-benzyl-7-chloro-3-oxoquinoxalin-2-yl)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(4-benzyl-7-chloro-3-keto-quinoxalin-2-yl)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C25H27ClN4O4 MolecularWeight: 482.95928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CCC2=NC3=C(C=CC(=C3)Cl)N(C2=O)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CCC2=NC3=C(C=CC(=C3)Cl)N(C2=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H27ClN4O4/c1-2-34-25(33)29-14-12-28(13-15-29)23(31)11-9-20-24(32)30(17-18-6-4-3-5-7-18)22-10-8-19(26)16-21(22)27-20/h3-8,10,16H,2,9,11-15,17H2,1H3