ethyl 3-azanyl-2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyridin-2-yl]carbonyl-6-chloranyl-indole-1-carboxylate

Systemtic Name: ethyl 3-azanyl-2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyridin-2-yl]carbonyl-6-chloranyl-indole-1-carboxylate Openeye Name: ethyl 3-amino-2-[4-[bis(tert-butoxycarbonyl)amino]pyridine-2-carbonyl]-6-chloro-indole-1-carboxylate CAS Name: 3-amino-2-[[4-[bis[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-pyridinyl]-oxomethyl]-6-chloro-1-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyridine-2-carbonyl]-6-chloroindole-1-carboxylate Traditional Name: 3-amino-2-[4-[bis(tert-butoxycarbonyl)amino]picolinoyl]-6-chloro-indole-1-carboxylic acid ethyl ester Formula: C27H31ClN4O7 MolecularWeight: 559.01064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=C(C=CC(=C2)Cl)C(=C1C(=O)C3=NC=CC(=C3)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)N

Isomeric SMILES

CCOC(=O)N1C2=C(C=CC(=C2)Cl)C(=C1C(=O)C3=NC=CC(=C3)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)N

InChI

InChI=1S/C27H31ClN4O7/c1-8-37-23(34)32-19-13-15(28)9-10-17(19)20(29)21(32)22(33)18-14-16(11-12-30-18)31(24(35)38-26(2,3)4)25(36)39-27(5,6)7/h9-14H,8,29H2,1-7H3