2-(8-aminocarbonyl-5-cyano-1-propyl-2,3,4,4a,9,9a-hexahydrocarbazol-1-yl)ethanoic acid

Systemtic Name: 2-(8-aminocarbonyl-5-cyano-1-propyl-2,3,4,4a,9,9a-hexahydrocarbazol-1-yl)ethanoic acid Openeye Name: 2-(8-carbamoyl-5-cyano-1-propyl-2,3,4,4a,9,9a-hexahydrocarbazol-1-yl)acetic acid CAS Name: 2-(8-carbamoyl-5-cyano-1-propyl-2,3,4,4a,9,9a-hexahydrocarbazol-1-yl)acetic acid IUPAC Name: 2-(8-carbamoyl-5-cyano-1-propyl-2,3,4,4a,9,9a-hexahydrocarbazol-1-yl)acetic acid Traditional Name: 2-(8-carbamoyl-5-cyano-1-propyl-2,3,4,4a,9,9a-hexahydrocarbazol-1-yl)acetic acid Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCCC2C1NC3=C(C=CC(=C23)C#N)C(=O)N)CC(=O)O

Isomeric SMILES

CCCC1(CCCC2C1NC3=C(C=CC(=C23)C#N)C(=O)N)CC(=O)O

InChI

InChI=1S/C19H23N3O3/c1-2-7-19(9-14(23)24)8-3-4-12-15-11(10-20)5-6-13(18(21)25)16(15)22-17(12)19/h5-6,12,17,22H,2-4,7-9H2,1H3,(H2,21,25)(H,23,24)