(Z)-but-2-enedioic acid; 1-[(Z)-(6-methoxy-3H-inden-1-yl)methylideneamino]-2-pentyl-guanidine

Systemtic Name: (Z)-but-2-enedioic acid; 1-[(Z)-(6-methoxy-3H-inden-1-yl)methylideneamino]-2-pentyl-guanidine Openeye Name: maleic acid; 1-[(Z)-(6-methoxy-3H-inden-1-yl)methyleneamino]-2-pentyl-guanidine CAS Name: (Z)-2-butenedioic acid; 1-[(Z)-(6-methoxy-3H-inden-1-yl)methylideneamino]-2-pentylguanidine IUPAC Name: (Z)-but-2-enedioic acid; 1-[(Z)-(6-methoxy-3H-inden-1-yl)methylideneamino]-2-pentylguanidine Traditional Name: 2-amyl-1-[(Z)-(6-methoxy-3H-inden-1-yl)methyleneamino]guanidine; maleic acid Formula: C21H28N4O5 MolecularWeight: 416.47082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN=C(N)NN=CC1=CCC2=C1C=C(C=C2)OC.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCCCCN=C(N)N/N=C\C1=CCC2=C1C=C(C=C2)OC.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C17H24N4O.C4H4O4/c1-3-4-5-10-19-17(18)21-20-12-14-7-6-13-8-9-15(22-2)11-16(13)14;5-3(6)1-2-4(7)8/h7-9,11-12H,3-6,10H2,1-2H3,(H3,18,19,21);1-2H,(H,5,6)(H,7,8)/b20-12-;2-1-