1-chloranyl-8,8-dimethyl-4-oxidanylidene-3-(3-phenylpropylamino)-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid

Systemtic Name: 1-chloranyl-8,8-dimethyl-4-oxidanylidene-3-(3-phenylpropylamino)-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid Openeye Name: 1-chloro-8,8-dimethyl-4-oxo-3-(3-phenylpropylamino)-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid CAS Name: 1-chloro-8,8-dimethyl-4-oxo-3-(3-phenylpropylamino)-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid IUPAC Name: 1-chloro-8,8-dimethyl-4-oxo-3-(3-phenylpropylamino)-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid Traditional Name: 1-chloro-4-keto-8,8-dimethyl-3-(3-phenylpropylamino)-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid Formula: C19H22ClN3O3 MolecularWeight: 375.84928

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(N2C1=C(N=C(C2=O)NCCCC3=CC=CC=C3)Cl)C(=O)O)C

Isomeric SMILES

CC1(CC(N2C1=C(N=C(C2=O)NCCCC3=CC=CC=C3)Cl)C(=O)O)C

InChI

InChI=1S/C19H22ClN3O3/c1-19(2)11-13(18(25)26)23-14(19)15(20)22-16(17(23)24)21-10-6-9-12-7-4-3-5-8-12/h3-5,7-8,13H,6,9-11H2,1-2H3,(H,21,22)(H,25,26)