5-oxidanylidene-5-[[(2S)-1-oxidanylidene-1-[(9-oxidanylidene-8aH-acridin-2-yl)amino]-3-phenyl-propan-2-yl]amino]pentanoic acid

Systemtic Name: 5-oxidanylidene-5-[[(2S)-1-oxidanylidene-1-[(9-oxidanylidene-8aH-acridin-2-yl)amino]-3-phenyl-propan-2-yl]amino]pentanoic acid Openeye Name: 5-[[(1S)-1-benzyl-2-oxo-2-[(9-oxo-8aH-acridin-2-yl)amino]ethyl]amino]-5-oxo-pentanoic acid CAS Name: 5-oxo-5-[[(2S)-1-oxo-1-[(9-oxo-8aH-acridin-2-yl)amino]-3-phenylpropan-2-yl]amino]pentanoic acid IUPAC Name: 5-oxo-5-[[(2S)-1-oxo-1-[(9-oxo-8aH-acridin-2-yl)amino]-3-phenylpropan-2-yl]amino]pentanoic acid Traditional Name: 5-[[(1S)-1-benzyl-2-keto-2-[(9-keto-8aH-acridin-2-yl)amino]ethyl]amino]-5-keto-valeric acid Formula: C27H25N3O5 MolecularWeight: 471.5045

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=CC3=C(C=C2)N=C4C=CC=CC4C3=O)NC(=O)CCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NC2=CC3=C(C=C2)N=C4C=CC=CC4C3=O)NC(=O)CCCC(=O)O

InChI

InChI=1S/C27H25N3O5/c31-24(11-6-12-25(32)33)30-23(15-17-7-2-1-3-8-17)27(35)28-18-13-14-22-20(16-18)26(34)19-9-4-5-10-21(19)29-22/h1-5,7-10,13-14,16,19,23H,6,11-12,15H2,(H,28,35)(H,30,31)(H,32,33)/t19?,23-/m0/s1