3-[[3-(tert-butylamino)-2-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]carbonylamino]-3-(3-nitrophenyl)propanoic acid

Systemtic Name: 3-[[3-(tert-butylamino)-2-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]carbonylamino]-3-(3-nitrophenyl)propanoic acid Openeye Name: 3-[[3-(tert-butylamino)-2-(3-methoxyphenyl)imidazo[1,2-a]pyridine-8-carbonyl]amino]-3-(3-nitrophenyl)propanoic acid CAS Name: 3-[[[3-(tert-butylamino)-2-(3-methoxyphenyl)-8-imidazo[1,2-a]pyridinyl]-oxomethyl]amino]-3-(3-nitrophenyl)propanoic acid IUPAC Name: 3-[[3-(tert-butylamino)-2-(3-methoxyphenyl)imidazo[1,2-a]pyridine-8-carbonyl]amino]-3-(3-nitrophenyl)propanoic acid Traditional Name: 3-[[3-(tert-butylamino)-2-(3-methoxyphenyl)imidazo[1,2-a]pyridine-8-carbonyl]amino]-3-(3-nitrophenyl)propionic acid Formula: C28H29N5O6 MolecularWeight: 531.55976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(N=C2N1C=CC=C2C(=O)NC(CC(=O)O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=CC=C4)OC

Isomeric SMILES

CC(C)(C)NC1=C(N=C2N1C=CC=C2C(=O)NC(CC(=O)O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=CC=C4)OC

InChI

InChI=1S/C28H29N5O6/c1-28(2,3)31-26-24(18-9-6-11-20(15-18)39-4)30-25-21(12-7-13-32(25)26)27(36)29-22(16-23(34)35)17-8-5-10-19(14-17)33(37)38/h5-15,22,31H,16H2,1-4H3,(H,29,36)(H,34,35)