2-(5,6-dihydrobenzo[h]quinazolin-4-ylamino)-4-methyl-pentanoic acid

Systemtic Name: 2-(5,6-dihydrobenzo[h]quinazolin-4-ylamino)-4-methyl-pentanoic acid Openeye Name: 2-(5,6-dihydrobenzo[h]quinazolin-4-ylamino)-4-methyl-pentanoic acid CAS Name: 2-(5,6-dihydrobenzo[h]quinazolin-4-ylamino)-4-methylpentanoic acid IUPAC Name: 2-(5,6-dihydrobenzo[h]quinazolin-4-ylamino)-4-methylpentanoic acid Traditional Name: 2-(5,6-dihydrobenzo[h]quinazolin-4-ylamino)-4-methyl-valeric acid Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC1=NC=NC2=C1CCC3=CC=CC=C32

Isomeric SMILES

CC(C)CC(C(=O)O)NC1=NC=NC2=C1CCC3=CC=CC=C32

InChI

InChI=1S/C18H21N3O2/c1-11(2)9-15(18(22)23)21-17-14-8-7-12-5-3-4-6-13(12)16(14)19-10-20-17/h3-6,10-11,15H,7-9H2,1-2H3,(H,22,23)(H,19,20,21)