2-[5-(aminomethyl)thiophen-2-yl]-1-cyclopropyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid

Systemtic Name: 2-[5-(aminomethyl)thiophen-2-yl]-1-cyclopropyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid Openeye Name: 2-[5-(aminomethyl)-2-thienyl]-1-cyclopropyl-9-methyl-4-oxo-quinolizine-3-carboxylic acid CAS Name: 2-[5-(aminomethyl)-2-thiophenyl]-1-cyclopropyl-9-methyl-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 2-[5-(aminomethyl)thiophen-2-yl]-1-cyclopropyl-9-methyl-4-oxoquinolizine-3-carboxylic acid Traditional Name: 2-[5-(aminomethyl)-2-thienyl]-1-cyclopropyl-4-keto-9-methyl-quinolizine-3-carboxylic acid Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=C(C(=C(C2=O)C(=O)O)C3=CC=C(S3)CN)C4CC4

Isomeric SMILES

CC1=CC=CN2C1=C(C(=C(C2=O)C(=O)O)C3=CC=C(S3)CN)C4CC4

InChI

InChI=1S/C19H18N2O3S/c1-10-3-2-8-21-17(10)14(11-4-5-11)15(16(18(21)22)19(23)24)13-7-6-12(9-20)25-13/h2-3,6-8,11H,4-5,9,20H2,1H3,(H,23,24)