2-[2-[(5-methoxy-1H-indol-2-yl)carbonylamino]-4-(phenylmethoxycarbonylamino)naphthalen-1-yl]ethyl methanesulfonate

Systemtic Name: 2-[2-[(5-methoxy-1H-indol-2-yl)carbonylamino]-4-(phenylmethoxycarbonylamino)naphthalen-1-yl]ethyl methanesulfonate Openeye Name: 2-[4-(benzyloxycarbonylamino)-2-[(5-methoxy-1H-indole-2-carbonyl)amino]-1-naphthyl]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[2-[[(5-methoxy-1H-indol-2-yl)-oxomethyl]amino]-4-(phenylmethoxycarbonylamino)-1-naphthalenyl]ethyl ester IUPAC Name: 2-[2-[(5-methoxy-1H-indole-2-carbonyl)amino]-4-(phenylmethoxycarbonylamino)naphthalen-1-yl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[4-(benzyloxycarbonylamino)-2-[(5-methoxy-1H-indole-2-carbonyl)amino]-1-naphthyl]ethyl ester Formula: C31H29N3O7S MolecularWeight: 587.64286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=C2)C(=O)NC3=C(C4=CC=CC=C4C(=C3)NC(=O)OCC5=CC=CC=C5)CCOS(=O)(=O)C

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=C2)C(=O)NC3=C(C4=CC=CC=C4C(=C3)NC(=O)OCC5=CC=CC=C5)CCOS(=O)(=O)C

InChI

InChI=1S/C31H29N3O7S/c1-39-22-12-13-26-21(16-22)17-29(32-26)30(35)33-27-18-28(34-31(36)40-19-20-8-4-3-5-9-20)24-11-7-6-10-23(24)25(27)14-15-41-42(2,37)38/h3-13,16-18,32H,14-15,19H2,1-2H3,(H,33,35)(H,34,36)